![benzamide, N-[2-(3-methylphenoxy)ethyl]-2-(methylthio)-](/api/spectrum/5lRPHkVOy8L/structure.png?h=300&w=458 "benzamide, N-[2-(3-methylphenoxy)ethyl]-2-(methylthio)-")
| SpectraBase Compound ID | G71IAZNV82D |
|---|---|
| InChI | InChI=1S/C17H19NO2S/c1-13-6-5-7-14(12-13)20-11-10-18-17(19)15-8-3-4-9-16(15)21-2/h3-9,12H,10-11H2,1-2H3,(H,18,19) |
| InChIKey | RATAMIMJLWWYDU-UHFFFAOYSA-N |
| Mol Weight | 301.4 g/mol |
| Molecular Formula | C17H19NO2S |
| Exact Mass | 301.11365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5lRPHkVOy8L |
|---|---|
| Name | Benzamide, N-[2-(3-methylphenoxy)ethyl]-2-(methylthio)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.113650028 u |
| Formula | C17H19NO2S |
| InChI | InChI=1S/C17H19NO2S/c1-13-6-5-7-14(12-13)20-11-10-18-17(19)15-8-3-4-9-16(15)21-2/h3-9,12H,10-11H2,1-2H3,(H,18,19) |
| InChIKey | RATAMIMJLWWYDU-UHFFFAOYSA-N |
| SMILES | N(C(C1=C(SC)C=CC=C1)=O)CCOC1=CC(C)=CC=C1 |